2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine

C14H12BrN3 — CID 117132720

IUPAC2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine
SMILESNc1cccc2nc(Cc3ccccc3Br)cn12
InChIInChI=1S/C14H12BrN3/c15-12-5-2-1-4-10(12)8-11-9-18-13(16)6-3-7-14(18)17-11/h1-7,9H,8,16H2
InChIKeyAQWZZJKBWDKGJK-UHFFFAOYSA-N
MW302.18 g/mol
LogP3.27
Rot. Bonds2

About 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine

2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine (PubChem CID 117132720) has the molecular formula C14H12BrN3 and a molecular weight of 302.18 g/mol. Its IUPAC name is 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine.

Molecular Properties

Compound Name2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine
PubChem CID117132720
Molecular FormulaC14H12BrN3
Molecular Weight302.18 g/mol
Exact Mass301.02
IUPAC Name2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine
SMILESNc1cccc2nc(Cc3ccccc3Br)cn12
InChIInChI=1S/C14H12BrN3/c15-12-5-2-1-4-10(12)8-11-9-18-13(16)6-3-7-14(18)17-11/h1-7,9H,8,16H2
InChIKeyAQWZZJKBWDKGJK-UHFFFAOYSA-N
XLogP3.27
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.18
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine?
The IUPAC name of 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine (CID 117132720) is 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine.
What is the SMILES notation for 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine?
The canonical SMILES for 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine is Nc1cccc2nc(Cc3ccccc3Br)cn12.
What is the InChIKey of 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine?
The InChIKey is AQWZZJKBWDKGJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrN3/c15-12-5-2-1-4-10(12)8-11-9-18-13(16)6-3-7-14(18)17-11/h1-7,9H,8,16H2.
What are the key properties of 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine?
2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine has a molecular weight of 302.18 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-5-amine is sourced from PubChem (CID 117132720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).